trimethyl-[3-[7-methyl-6-[tris(2-methylpropyl)silyl]furo[3,2-d]pyrimidin-4-yl]naphthalen-1-yl]silane

C32H46N2OSi2 — CID 176855366

IUPACtrimethyl-[3-[7-methyl-6-[tris(2-methylpropyl)silyl]furo[3,2-d]pyrimidin-4-yl]naphthalen-1-yl]silane
SMILESCc1c([Si](CC(C)C)(CC(C)C)CC(C)C)oc2c(-c3cc([Si](C)(C)C)c4ccccc4c3)ncnc12
InChIInChI=1S/C32H46N2OSi2/c1-21(2)17-37(18-22(3)4,19-23(5)6)32-24(7)29-31(35-32)30(34-20-33-29)26-15-25-13-11-12-14-27(25)28(16-26)36(8,9)10/h11-16,20-23H,17-19H2,1-10H3
InChIKeyBHFMTBZVVIAUST-UHFFFAOYSA-N
MW530.91 g/mol
LogP8.52
Rot. Bonds9

About trimethyl-[3-[7-methyl-6-[tris(2-methylpropyl)silyl]furo[3,2-d]pyrimidin-4-yl]naphthalen-1-yl]silane

trimethyl-[3-[7-methyl-6-[tris(2-methylpropyl)silyl]furo[3,2-d]pyrimidin-4-yl]naphthalen-1-yl]silane (PubChem CID 176855366) has the molecular formula C32H46N2OSi2 and a molecular weight of 530.91 g/mol. Its IUPAC name is trimethyl-[3-[7-methyl-6-[tris(2-methylpropyl)silyl]furo[3,2-d]pyrimidin-4-yl]naphthalen-1-yl]silane.

Molecular Properties

Compound Nametrimethyl-[3-[7-methyl-6-[tris(2-methylpropyl)silyl]furo[3,2-d]pyrimidin-4-yl]naphthalen-1-yl]silane
PubChem CID176855366
Molecular FormulaC32H46N2OSi2
Molecular Weight530.91 g/mol
Exact Mass530.31
IUPAC Nametrimethyl-[3-[7-methyl-6-[tris(2-methylpropyl)silyl]furo[3,2-d]pyrimidin-4-yl]naphthalen-1-yl]silane
SMILESCc1c([Si](CC(C)C)(CC(C)C)CC(C)C)oc2c(-c3cc([Si](C)(C)C)c4ccccc4c3)ncnc12
InChIInChI=1S/C32H46N2OSi2/c1-21(2)17-37(18-22(3)4,19-23(5)6)32-24(7)29-31(35-32)30(34-20-33-29)26-15-25-13-11-12-14-27(25)28(16-26)36(8,9)10/h11-16,20-23H,17-19H2,1-10H3
InChIKeyBHFMTBZVVIAUST-UHFFFAOYSA-N
XLogP8.52
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500530.91
LogP ≤ 58.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

trimethyl-[3-[6-(2-methylpropyl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]naphthalen-1-yl]silane
CID 170932085
dicyclohexyl-methyl-[7-methyl-4-(4-trimethylsilylnaphthalen-2-yl)thieno[3,2-d]pyrimidin-6-yl]silane
CID 176855311
13-(4-tert-butylnaphthalen-2-yl)-6-(2-methylpropyl)-11-oxa-14,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,12(17),13,15-heptaene
CID 171581324
[3-(5,6-dihydropyrido[3,2-h]quinazolin-4-yl)naphthalen-1-yl]-trimethylsilane
CID 177070391
trimethyl-[3-[8-(2-methylpropyl)-[1]benzothiolo[2,3-c]pyridin-1-yl]naphthalen-1-yl]silane
CID 170932025
[3-(12-fluoro-4,5-dimethyl-3-oxa-7-thia-10-azatricyclo[6.4.0.02,6]dodeca-1(8),2(6),4,9,11-pentaen-9-yl)naphthalen-1-yl]-trimethylsilane
CID 177073393
[3-[7-(2,2-difluoroethyl)-[1]benzothiolo[3,2-d]pyrimidin-4-yl]naphthalen-1-yl]-triethylsilane
CID 176623417
15-(4-propan-2-ylphenyl)-17-oxa-12,14-diazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),12,14-octaene
CID 168815880
[3-[7-(2,2-dimethylpropyl)-[1]benzothiolo[3,2-d]pyrimidin-4-yl]naphthalen-1-yl]-tri(propan-2-yl)silane
CID 176855199
trimethyl-[1-[4-(2-methylpropyl)naphthalen-2-yl]-[1]benzofuro[2,3-c]pyridin-6-yl]germane
CID 166018585
17-methyl-15-(4-propan-2-ylnaphthalen-2-yl)-12,14,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene
CID 168816669
12-(4-tert-butylnaphthalen-2-yl)-3-(2-methylpropyl)-17-oxa-13,15-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,8,11,13,15-octaene
CID 168816142

Frequently Asked Questions

What is the IUPAC name of trimethyl-[3-[7-methyl-6-[tris(2-methylpropyl)silyl]furo[3,2-d]pyrimidin-4-yl]naphthalen-1-yl]silane?
The IUPAC name of trimethyl-[3-[7-methyl-6-[tris(2-methylpropyl)silyl]furo[3,2-d]pyrimidin-4-yl]naphthalen-1-yl]silane (CID 176855366) is trimethyl-[3-[7-methyl-6-[tris(2-methylpropyl)silyl]furo[3,2-d]pyrimidin-4-yl]naphthalen-1-yl]silane.
What is the SMILES notation for trimethyl-[3-[7-methyl-6-[tris(2-methylpropyl)silyl]furo[3,2-d]pyrimidin-4-yl]naphthalen-1-yl]silane?
The canonical SMILES for trimethyl-[3-[7-methyl-6-[tris(2-methylpropyl)silyl]furo[3,2-d]pyrimidin-4-yl]naphthalen-1-yl]silane is Cc1c([Si](CC(C)C)(CC(C)C)CC(C)C)oc2c(-c3cc([Si](C)(C)C)c4ccccc4c3)ncnc12.
What is the InChIKey of trimethyl-[3-[7-methyl-6-[tris(2-methylpropyl)silyl]furo[3,2-d]pyrimidin-4-yl]naphthalen-1-yl]silane?
The InChIKey is BHFMTBZVVIAUST-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H46N2OSi2/c1-21(2)17-37(18-22(3)4,19-23(5)6)32-24(7)29-31(35-32)30(34-20-33-29)26-15-25-13-11-12-14-27(25)28(16-26)36(8,9)10/h11-16,20-23H,17-19H2,1-10H3.
What are the key properties of trimethyl-[3-[7-methyl-6-[tris(2-methylpropyl)silyl]furo[3,2-d]pyrimidin-4-yl]naphthalen-1-yl]silane?
trimethyl-[3-[7-methyl-6-[tris(2-methylpropyl)silyl]furo[3,2-d]pyrimidin-4-yl]naphthalen-1-yl]silane has a molecular weight of 530.91 g/mol, XLogP of 8.52, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[3-[7-methyl-6-[tris(2-methylpropyl)silyl]furo[3,2-d]pyrimidin-4-yl]naphthalen-1-yl]silane is sourced from PubChem (CID 176855366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).